4-Methylphenyl benzoate - ≥98% , CAS No.614-34-6

CAS: 614-34-6 Cat. No.: M474361 Fórmula: C14H12O2 Peso molecular: 212.24
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
p-Tolyl benzoate | 4-Cresyl benzoate
Storage
Room temperature
Shipped In
Normal
★
Size
Alemania (EU)
USA*
Price
Qty
1g
M474361-1g
Fabricado bajo pedido · 8–12 semanas
8,59€
5g
M474361-5g
Fabricado bajo pedido · 8–12 semanas
17,27€
25g
M474361-25g
Fabricado bajo pedido · 8–12 semanas
60,65€
100g
M474361-100g
Fabricado bajo pedido · 8–12 semanas
202,96€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Description

4-Methylphenyl benzoate is an ester. Structure of 4-methylphenyl benzoate resembles phenyl benzoate and 4-methoxy\xadphenyl benzoate, in terms of similar geometric parameters. The dihedral angle between the phenyl and benzene rings in 4-methylphenyl benzoate is 60.17 (7)°. Fries rearrangement of 4-methoxy\xadphenyl benzoate catalyzed by sulfated zirconia is reported.

Specifications

Sinónimos
p-Tolyl benzoate | 4-Cresyl benzoate
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Sonrisas canónicas
CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2
IUPAC Name
(4-methylphenyl) benzoate
InChIKey
LLRZUDIHEZXFGV-UHFFFAOYSA-N
INCHI
1S/C14H12O2/c1-11-7-9-13(10-8-11)16-14(15)12-5-3-2-4-6-12/h2-10H,1H3
Isómeros SMILES
CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2
WGK Alemania
2
RTECS
DH7050000
Peso molecular
212.24
Reaxy-Rn
1873141
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1873141&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
ClaseDepsides and depsidones
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentDepsides and depsidones
Alternative Parents Phenol esters  Benzoic acid esters  Phenoxy compounds  Benzoyl derivatives  Toluenes  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Depside backbone - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Toluene - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeFechaArticulo
I2617658Certificate of AnalysisApr 15, 2026 M474361
I2617659Certificate of AnalysisApr 15, 2026 M474361
I2617660Certificate of AnalysisApr 15, 2026 M474361
I2617661Certificate of AnalysisApr 15, 2026 M474361
Propiedades químicas y físicas
Punto de fusión (°C)69.0 to 73.0 °C
Peso molecular212.240 g/mol
XLogP34.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass212.084 Da
Monoisotopic Mass212.084 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count16
Formal Charge0
Complexity223.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
Reseñas

Reseñas de cliente

¿Quieres que te enviemos un mensaje cuando tengamos descuentos disponibles?

Recordármelo más tarde

¡Gracias! Por favor, revisa tu bandeja de entrada de correo electrónico para confirmar.

¡Vaya! Las notificaciones están desactivadas.